| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 20 | Yes |
Popular Name: 4-[(3S)-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]butyl]phenol 4-[(3S)-3-[[(3R)-1-cyclopropylpy…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.79 | 5.07 | -44.09 | 3 | 3 | 1 | 40 | 275.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 4.02 | -4 | 2 | 3 | 0 | 35 | 274.408 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 6.3 | -35.35 | 3 | 3 | 1 | 37 | 275.416 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.79 | 7.32 | -115.62 | 4 | 3 | 2 | 41 | 276.424 | 6 | ↓ |
